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  1. Third-Parties
  2. MatprojStructure
  3. mp-774827

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-774827
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 5
  • Element list: ['Li', 'V', 'Cr', 'Te', 'O']
  • Chemical System: Cr-Li-O-Te-V
  • Density: 4.224573995891241
  • Atomic Density: 0.10151299722579557
  • Unit Cell Volume: 197.0191063860912
  • Molar Volume: 5.9323839553322815
  • Full Formula: Li4 V2 Cr1 Te1 O12
  • Reduced Formula: Li4V2CrTeO12
  • Formula Anonymous: ABC2D4E12
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -140.20972175999998
  • Final energy per atom: -7.010486087999999
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.